2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid

C7H11NO4 — CID 141320304

IUPAC2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid
SMILESCOC(C(=O)O)N1CCCC1=O
InChIInChI=1S/C7H11NO4/c1-12-6(7(10)11)8-4-2-3-5(8)9/h6H,2-4H2,1H3,(H,10,11)
InChIKeyAWEDMGGIDAENIW-UHFFFAOYSA-N
MW173.17 g/mol
LogP-0.33
Rot. Bonds3

About 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid

2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid (PubChem CID 141320304) has the molecular formula C7H11NO4 and a molecular weight of 173.17 g/mol. Its IUPAC name is 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid.

Molecular Properties

Compound Name2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid
PubChem CID141320304
Molecular FormulaC7H11NO4
Molecular Weight173.17 g/mol
Exact Mass173.07
IUPAC Name2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid
SMILESCOC(C(=O)O)N1CCCC1=O
InChIInChI=1S/C7H11NO4/c1-12-6(7(10)11)8-4-2-3-5(8)9/h6H,2-4H2,1H3,(H,10,11)
InChIKeyAWEDMGGIDAENIW-UHFFFAOYSA-N
XLogP-0.33
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Pyrrolidineacetic acid, 2-oxo-, 2-(dimethylamino)ethyl ester, ethanedioate (1:1)
CID 3076740
[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-acetic acid
CID 6485711
2-(2,5-Dioxopyrrolidin-1-yl)-2-hydroxyacetic acid
CID 14112493
2-Hydroxy-2-(2-oxopyrrolidin-1-yl)acetic acid
CID 15283689
(2-Oxo-1-pyrrolidinyl)-acetic acid carboethoxymethyl ester
CID 15307546
(R/S)-2-(3-acetoxy-2-oxo-1-pyrrolidinyl)acetic acid
CID 54389912
2-[(3R)-3-acetyloxy-2-oxopyrrolidin-1-yl]acetic acid
CID 57077235
Ethenyl 2-hydroxy-2-(2-oxopyrrolidin-1-yl)acetate
CID 67572682
2-Acetyloxy-2-(2,5-dioxopyrrolidin-1-yl)acetic acid
CID 68313763
2-(2,5-Dioxopyrrolidin-1-yl)-2-(2-hydroxyethoxy)acetic acid
CID 68755410
2-Methoxy-2-pyrrolidin-1-ylacetic acid
CID 83681022
2-[Methyl-[2-oxo-2-[2-(2-oxopyrrolidin-1-yl)ethoxy]acetyl]amino]acetic acid
CID 123812501

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid?
The IUPAC name of 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid (CID 141320304) is 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid.
What is the SMILES notation for 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid?
The canonical SMILES for 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid is COC(C(=O)O)N1CCCC1=O.
What is the InChIKey of 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid?
The InChIKey is AWEDMGGIDAENIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO4/c1-12-6(7(10)11)8-4-2-3-5(8)9/h6H,2-4H2,1H3,(H,10,11).
What are the key properties of 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid?
2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid has a molecular weight of 173.17 g/mol, XLogP of -0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-(2-oxopyrrolidin-1-yl)acetic acid is sourced from PubChem (CID 141320304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).